Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(III)
Catalog Number
ACM181418644-1
CAS
181418-64-4
IUPAC Name
(Z)-5-Hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;titanium
Synonyms
(Z)-5-Hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;titanium
Molecular Weight
600.7
Molecular Formula
C33H60O6Ti
Product Information
Canonical SMILES
CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Ti]
InChI
InChI=1S/3C11H20O2.Ti/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7,12H,1-6H3;/b3*8-7-;
InChI Key
GDCBFXOQZJSCHZ-LWTKGLMZSA-N
Boiling Point
75 °C/0.1mmHg (lit.)
Purity
95%+
Appearance
Purple crystal
Storage
Sealed in dry,Room Temperature
Complexity
801
Covalently-Bonded Unit Count
4
Exact Mass
600.3869303
Heavy Atom Count
40
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
3
Monoisotopic Mass
600.3869303
Rotatable Bond Count
9
Topological Polar Surface Area
112 Ų
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